6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol

C16H17NO — CID 10466776

IUPAC6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESOc1ccc2c(c1)CCC(Cc1ccncc1)C2
InChIInChI=1S/C16H17NO/c18-16-4-3-14-10-13(1-2-15(14)11-16)9-12-5-7-17-8-6-12/h3-8,11,13,18H,1-2,9-10H2
InChIKeyHOYYGGIWRKOTDQ-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.13
Rot. Bonds2

About 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol

6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol (PubChem CID 10466776) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol
PubChem CID10466776
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESOc1ccc2c(c1)CCC(Cc1ccncc1)C2
InChIInChI=1S/C16H17NO/c18-16-4-3-14-10-13(1-2-15(14)11-16)9-12-5-7-17-8-6-12/h3-8,11,13,18H,1-2,9-10H2
InChIKeyHOYYGGIWRKOTDQ-UHFFFAOYSA-N
XLogP3.13
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,4'-Dihydroxydiphenyl(2-pyridyl)methane
CID 69046
Isoquinolin-5-ol
CID 30386
Cyprolidol
CID 199758
8-Hydroxyisoquinoline
CID 135441711
3-(6-Methoxynaphthalen-2-yl)-4-methylpyridine
CID 25034430
3-{[(1E)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-ylidene]methyl}pyridine
CID 6539771
(3-Pyridylmethylene)tetrahydronaphthalene 13b
CID 6539772
4-{[(1E)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-ylidene]methyl}pyridine
CID 6539798
(4-Pyridylmethylene)tetrahydronaphthalene 14b
CID 6539799
3-(6-Methoxy-3,4-dihydronaphthalen-2-yl)pyridine
CID 6540049
3-(7-Methoxy-3,4-dihydronaphthalen-2-yl)pyridine
CID 6540057
3-(6-Methoxynaphthalen-2-yl)pyridine
CID 11506923

Frequently Asked Questions

What is the IUPAC name of 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol?
The IUPAC name of 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol (CID 10466776) is 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol.
What is the SMILES notation for 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol?
The canonical SMILES for 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol is Oc1ccc2c(c1)CCC(Cc1ccncc1)C2.
What is the InChIKey of 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol?
The InChIKey is HOYYGGIWRKOTDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c18-16-4-3-14-10-13(1-2-15(14)11-16)9-12-5-7-17-8-6-12/h3-8,11,13,18H,1-2,9-10H2.
What are the key properties of 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol?
6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol has a molecular weight of 239.32 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 10466776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).